(3aS,5S,9aS)-5-(2-fluoranyl-5-methoxy-phenyl)-2-[(2-methoxyphenyl)methyl]-3,3a,4,5,6,7,8,9-octahydropyrrolo[3,4-h]pyrrolizin-6-ium-1-one

Systemtic Name: (3aS,5S,9aS)-5-(2-fluoranyl-5-methoxy-phenyl)-2-[(2-methoxyphenyl)methyl]-3,3a,4,5,6,7,8,9-octahydropyrrolo[3,4-h]pyrrolizin-6-ium-1-one Openeye Name: (3aS,5S,9aS)-5-(2-fluoro-5-methoxy-phenyl)-2-[(2-methoxyphenyl)methyl]-3,3a,4,5,6,7,8,9-octahydropyrrolo[3,4-h]pyrrolizin-6-ium-1-one CAS Name: (3aS,5S,9aS)-5-(2-fluoro-5-methoxyphenyl)-2-[(2-methoxyphenyl)methyl]-3,3a,4,5,6,7,8,9-octahydropyrrolo[3,4-h]pyrrolizin-6-ium-1-one IUPAC Name: (3aS,5S,9aS)-5-(2-fluoro-5-methoxyphenyl)-2-[(2-methoxyphenyl)methyl]-3,3a,4,5,6,7,8,9-octahydropyrrolo[3,4-h]pyrrolizin-6-ium-1-one Traditional Name: (3aS,5S,9aS)-5-(2-fluoro-5-methoxy-phenyl)-2-o-anisyl-3,3a,4,5,6,7,8,9-octahydropyrrolo[3,4-h]pyrrolizin-6-ium-1-one Formula: C24H28FN2O3+ MolecularWeight: 411.489123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)F)C2CC3CN(C(=O)C34[NH+]2CCC4)CC5=CC=CC=C5OC

Isomeric SMILES

COC1=CC(=C(C=C1)F)[C@@H]2C[C@H]3CN(C(=O)[C@@]34[NH+]2CCC4)CC5=CC=CC=C5OC

InChI

InChI=1S/C24H27FN2O3/c1-29-18-8-9-20(25)19(13-18)21-12-17-15-26(14-16-6-3-4-7-22(16)30-2)23(28)24(17)10-5-11-27(21)24/h3-4,6-9,13,17,21H,5,10-12,14-15H2,1-2H3/p+1/t17-,21-,24-/m0/s1